N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylfuro[3,2-c]pyridin-4-amine

C16H21N3O — CID 106535244

IUPACN-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylfuro[3,2-c]pyridin-4-amine
SMILESCCN(c1nccc2occc12)C1CC2CCC(C1)N2
InChIInChI=1S/C16H21N3O/c1-2-19(13-9-11-3-4-12(10-13)18-11)16-14-6-8-20-15(14)5-7-17-16/h5-8,11-13,18H,2-4,9-10H2,1H3
InChIKeyIUGPZECVUWCZHN-UHFFFAOYSA-N
MW271.36 g/mol
LogP2.94
Rot. Bonds3

About N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylfuro[3,2-c]pyridin-4-amine

N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylfuro[3,2-c]pyridin-4-amine (PubChem CID 106535244) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylfuro[3,2-c]pyridin-4-amine.

Molecular Properties

Compound NameN-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylfuro[3,2-c]pyridin-4-amine
PubChem CID106535244
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC NameN-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylfuro[3,2-c]pyridin-4-amine
SMILESCCN(c1nccc2occc12)C1CC2CCC(C1)N2
InChIInChI=1S/C16H21N3O/c1-2-19(13-9-11-3-4-12(10-13)18-11)16-14-6-8-20-15(14)5-7-17-16/h5-8,11-13,18H,2-4,9-10H2,1H3
InChIKeyIUGPZECVUWCZHN-UHFFFAOYSA-N
XLogP2.94
TPSA41.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylfuro[3,2-c]pyridin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylfuro[3,2-c]pyridin-4-amine?
The IUPAC name of N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylfuro[3,2-c]pyridin-4-amine (CID 106535244) is N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylfuro[3,2-c]pyridin-4-amine.
What is the SMILES notation for N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylfuro[3,2-c]pyridin-4-amine?
The canonical SMILES for N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylfuro[3,2-c]pyridin-4-amine is CCN(c1nccc2occc12)C1CC2CCC(C1)N2.
What is the InChIKey of N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylfuro[3,2-c]pyridin-4-amine?
The InChIKey is IUGPZECVUWCZHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-2-19(13-9-11-3-4-12(10-13)18-11)16-14-6-8-20-15(14)5-7-17-16/h5-8,11-13,18H,2-4,9-10H2,1H3.
What are the key properties of N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylfuro[3,2-c]pyridin-4-amine?
N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylfuro[3,2-c]pyridin-4-amine has a molecular weight of 271.36 g/mol, XLogP of 2.94, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylfuro[3,2-c]pyridin-4-amine is sourced from PubChem (CID 106535244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).